PUBCHEM-ZINC03752504 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 0.5090 0.5210 1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -0.4480 0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -1.1310 0.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3490 -2.0780 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -2.4030 -1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -3.3900 -2.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 -4.0540 -1.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 -3.7410 -0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 -2.7510 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2970 -4.4340 -0.4090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6750 -5.1490 0.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0170 -5.6150 0.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9190 -6.3830 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1830 -6.6780 0.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5570 -6.2180 -0.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6890 -5.4460 -1.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4220 -5.1670 -0.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3670 -4.4480 -1.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3750 -3.9860 -2.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1520 -4.9720 -2.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8430 -5.4390 1.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3650 -4.6850 3.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0420 -5.3830 3.9670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4410 1.0740 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3170 1.2360 1.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5630 -0.0130 2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 0.1160 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0990 -1.1600 0.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2390 -1.9100 -1.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -3.6460 -3.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 -4.8300 -2.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0500 -2.4950 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6360 -6.7340 2.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8790 -7.2660 1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5500 -6.4620 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0210 -4.3160 -2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3730 -4.4130 -3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4300 -5.8270 -3.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8530 -6.5180 2.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 -5.1710 1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0270 -3.4700 3.2390 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 2 0 0 0 0 22 41 1 0 0 0 0 M CHG 1 41 -1 M END